MMs01843546 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7529 1.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2529 1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2471 -1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7471 -1.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0100 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4967 -1.5100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5033 1.4900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -0.0133 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2000 -0.0133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7471 -1.3140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4942 -2.6147 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7529 1.2841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2529 1.2808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0057 2.5782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5057 2.5748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2528 1.2741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0057 2.5848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7586 3.8822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0115 5.1829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7644 6.4802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1552 2.3379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8552 2.3320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8448 -2.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1448 -2.3386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3529 2.3233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0419 0.0995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3796 0.8679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4424 2.7846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2167 3.7595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0848 1.8155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0882 3.3582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2174 3.4955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6796 4.6515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2586 3.8722 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5115 5.1862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9138 6.2267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4586 3.8696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 3 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 M END